(5,7,8-trifluoro-2-phenylquinolin-4-yl)hydrazine

C15H10F3N3 — CID 62812421

IUPAC(5,7,8-trifluoro-2-phenylquinolin-4-yl)hydrazine
SMILESNNc1cc(-c2ccccc2)nc2c(F)c(F)cc(F)c12
InChIInChI=1S/C15H10F3N3/c16-9-6-10(17)14(18)15-13(9)12(21-19)7-11(20-15)8-4-2-1-3-5-8/h1-7H,19H2,(H,20,21)
InChIKeyLRAGSUDKQGXOOJ-UHFFFAOYSA-N
MW289.26 g/mol
LogP3.60
Rot. Bonds2

About (5,7,8-trifluoro-2-phenylquinolin-4-yl)hydrazine

(5,7,8-trifluoro-2-phenylquinolin-4-yl)hydrazine (PubChem CID 62812421) has the molecular formula C15H10F3N3 and a molecular weight of 289.26 g/mol. Its IUPAC name is (5,7,8-trifluoro-2-phenylquinolin-4-yl)hydrazine.

Molecular Properties

Compound Name(5,7,8-trifluoro-2-phenylquinolin-4-yl)hydrazine
PubChem CID62812421
Molecular FormulaC15H10F3N3
Molecular Weight289.26 g/mol
Exact Mass289.08
IUPAC Name(5,7,8-trifluoro-2-phenylquinolin-4-yl)hydrazine
SMILESNNc1cc(-c2ccccc2)nc2c(F)c(F)cc(F)c12
InChIInChI=1S/C15H10F3N3/c16-9-6-10(17)14(18)15-13(9)12(21-19)7-11(20-15)8-4-2-1-3-5-8/h1-7H,19H2,(H,20,21)
InChIKeyLRAGSUDKQGXOOJ-UHFFFAOYSA-N
XLogP3.60
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.26
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(5,8-difluoro-2-phenylquinolin-4-yl)hydrazine
CID 62250960
(5-bromo-8-fluoro-2-phenylquinolin-4-yl)hydrazine
CID 63482610
(5-bromo-6-fluoro-8-methyl-2-phenylquinolin-4-yl)hydrazine
CID 107594078
(7-fluoro-8-methyl-2-phenylquinolin-4-yl)hydrazine
CID 62251910
(5,7,8-trifluoro-2-propan-2-ylquinolin-4-yl)hydrazine
CID 62812079
(6,7-difluoro-2-phenylquinolin-4-yl)hydrazine
CID 62251146
(6-chloro-7-fluoro-2-phenylquinolin-4-yl)hydrazine
CID 113363447
(8-chloro-2-phenylquinolin-4-yl)hydrazine
CID 63483527
(6,8-dimethyl-2-phenylquinolin-4-yl)hydrazine
CID 63484238
(8-methoxy-2-phenylquinolin-4-yl)hydrazine
CID 62252630
4-chloro-5,8-difluoro-2-phenylquinoline
CID 43668636
7-fluoro-N,6-dimethyl-2-phenylquinolin-4-amine
CID 103996202

Frequently Asked Questions

What is the IUPAC name of (5,7,8-trifluoro-2-phenylquinolin-4-yl)hydrazine?
The IUPAC name of (5,7,8-trifluoro-2-phenylquinolin-4-yl)hydrazine (CID 62812421) is (5,7,8-trifluoro-2-phenylquinolin-4-yl)hydrazine.
What is the SMILES notation for (5,7,8-trifluoro-2-phenylquinolin-4-yl)hydrazine?
The canonical SMILES for (5,7,8-trifluoro-2-phenylquinolin-4-yl)hydrazine is NNc1cc(-c2ccccc2)nc2c(F)c(F)cc(F)c12.
What is the InChIKey of (5,7,8-trifluoro-2-phenylquinolin-4-yl)hydrazine?
The InChIKey is LRAGSUDKQGXOOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F3N3/c16-9-6-10(17)14(18)15-13(9)12(21-19)7-11(20-15)8-4-2-1-3-5-8/h1-7H,19H2,(H,20,21).
What are the key properties of (5,7,8-trifluoro-2-phenylquinolin-4-yl)hydrazine?
(5,7,8-trifluoro-2-phenylquinolin-4-yl)hydrazine has a molecular weight of 289.26 g/mol, XLogP of 3.60, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5,7,8-trifluoro-2-phenylquinolin-4-yl)hydrazine is sourced from PubChem (CID 62812421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).